SCHEMBL18334510

SCHEMBL18334510

CC(C1C(N)C(=O)N(c2ccccc2)N1C)C(C)(C)NC(=O)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ ELANE P08246 3/20 0.31
▸ TP53 P04637 1/20 0.31
▸ NPY5R Q15761 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ RAB9A P51151 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18334469 0.81 GAA (0.33) GAASMN1; SMN2ELANETP53NPY5R
SCHEMBL18334565 0.81 GAA (0.33) GAASMN1; SMN2ELANETP53NPY5R
SCHEMBL18334499 0.81 GAA (0.33) GAASMN1; SMN2ELANETP53NPY5R
SCHEMBL18334495 0.76 GAA (0.33) GAAELANEALDH1A1KDM4E
SCHEMBL18334440 0.76 CHRM2 (0.34) ELANE
SCHEMBL18015895 0.74 LMNA (0.36) GAATP53ALDH1A1KDM4EMAPT
SCHEMBL18334587 0.74 ESR1 (0.41) GAASMN1; SMN2ELANEALDH1A1
SCHEMBL18334505 0.73 CHRM2 (0.32) ELANE
SCHEMBL18334461 0.71 MTNR1A (0.40) GAATP53ALDH1A1MAPTRAB9A
SCHEMBL18334436 0.67 KDM4E (0.34) GAASMN1; SMN2ELANEALDH1A1KDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170107207-A1 AMINOPYRAZOLONE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2017-04-20 — — US disclosed
EP-3109239-A1 AMINOPYRAZOLONE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-12-28 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20170107207-A1 AMINOPYRAZOLONE DERIVATIVE ATAD5, ATP1A1, TIPRL GAA 2530/4885SMN1; SMN2 4135/4885ELANE 3829/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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